ethyl 4-(4-acetamidoanilino)-1-(4-acetamidophenyl)-2-methyl-5-oxopyrrole-2-carboxylate
TL;DR: ethyl 4-(4-acetamidoanilino)-1-(4-acetamidophenyl)-2-methyl-5-oxopyrrole-2-carboxylate (CAS 780790-31-0) is a chemical compound with molecular formula C24H26N4O5 and molecular weight 450.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(4-acetamidoanilino)-1-(4-acetamidophenyl)-2-methyl-5-oxopyrrole-2-carboxylate
Also Known As: ethyl 4-(4-acetamidoanilino)-1-(4-acetamidophenyl)-2-methyl-5-oxopyrrole-2-carboxylate, 1-(4-Acetylamino-phenyl)-4-(4-acetylamino-phenylamino)-2-methyl-5-oxo-2,5-dihydro-1H-pyrrole-2-car boxylic acid ethyl ester, ethyl 1-(4-acetamidophenyl)-4-((4-acetamidophenyl)amino)-2-methyl-5-oxo-2,5-dihydro-1H-pyrrole-2-carboxylate, Ethyl 1-(4-acetamidophenyl)-4-[(4-acetamidophenyl)amino]-2-methyl-5-oxo-pyrrole-2-carboxylate, ethyl 1-[4-(acetylamino)phenyl]-4-{[4-(acetylamino)phenyl]amino}-2-methyl-5-oxo-2,5-dihydro-1H-pyrrole-2-carboxylate
| Molecular Formula | C24H26N4O5 |
|---|---|
| Molecular Weight | 450.19 g/mol |
| LogP | 3.2678 |
| Topological Polar Surface Area | 116.84 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 450.1903 |
| Heavy Atoms | 33 |
| Complexity | 1108.6794 |
Chemical Identifiers
| CAS Number | 780790-31-0 |
|---|---|
| SMILES | CCOC(=O)C1(C=C(C(=O)N1C2=CC=C(C=C2)NC(=O)C)NC3=CC=C(C=C3)NC(=O)C)C |
Product Overview
ethyl 4-(4-acetamidoanilino)-1-(4-acetamidophenyl)-2-methyl-5-oxopyrrole-2-carboxylate (CAS 780790-31-0), with molecular formula C24H26N4O5 and molecular weight 450.19 g/mol. IUPAC: ethyl 4-(4-acetamidoanilino)-1-(4-acetamidophenyl)-2-methyl-5-oxopyrrole-2-carboxylate.
Chemical Property Profile of ethyl 4-(4-acetamidoanilino)-1-(4-acetamidophenyl)-2-methyl-5-oxopyrrole-2-carboxylate
Property Insights of ethyl 4-(4-acetamidoanilino)-1-(4-acetamidophenyl)-2-methyl-5-oxopyrrole-2-carboxylate
The XLogP value of 3.2678 indicates that ethyl 4-(4-acetamidoanilino)-1-(4-acetamidophenyl)-2-methyl-5-oxopyrrole-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 116.84 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 4-(4-acetamidoanilino)-1-(4-acetamidophenyl)-2-methyl-5-oxopyrrole-2-carboxylate. Following Lipinski's Rule of Five, ethyl 4-(4-acetamidoanilino)-1-(4-acetamidophenyl)-2-methyl-5-oxopyrrole-2-carboxylate has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ethyl 4-(4-acetamidoanilino)-1-(4-acetamidophenyl)-2-methyl-5-oxopyrrole-2-carboxylate?
The CAS number of ethyl 4-(4-acetamidoanilino)-1-(4-acetamidophenyl)-2-methyl-5-oxopyrrole-2-carboxylate is 780790-31-0.
What is the molecular formula of ethyl 4-(4-acetamidoanilino)-1-(4-acetamidophenyl)-2-methyl-5-oxopyrrole-2-carboxylate?
The molecular formula of ethyl 4-(4-acetamidoanilino)-1-(4-acetamidophenyl)-2-methyl-5-oxopyrrole-2-carboxylate is C24H26N4O5.
What is the molecular weight of ethyl 4-(4-acetamidoanilino)-1-(4-acetamidophenyl)-2-methyl-5-oxopyrrole-2-carboxylate?
The molecular weight of ethyl 4-(4-acetamidoanilino)-1-(4-acetamidophenyl)-2-methyl-5-oxopyrrole-2-carboxylate is 450.19 g/mol.
Where can I buy ethyl 4-(4-acetamidoanilino)-1-(4-acetamidophenyl)-2-methyl-5-oxopyrrole-2-carboxylate?
You can request a quote for ethyl 4-(4-acetamidoanilino)-1-(4-acetamidophenyl)-2-methyl-5-oxopyrrole-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 4-(4-acetamidoanilino)-1-(4-acetamidophenyl)-2-methyl-5-oxopyrrole-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 4-(4-acetamidoanilino)-1-(4-acetamidophenyl)-2-methyl-5-oxopyrrole-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.